In-Silico Structure database (LMISSD)
| |
LM ID | LMGP04039DD9 |
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Common Name | PG(P-14:0/18:3(6Z,9Z,12Z)) |
Systematic Name | 1-(1Z-tetradecenyl)-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phospho-(1'-sn- glycerol) |
Synonyms | PG(P-32:3); PG(P-14:0/18:3) |
Exact Mass | |
Formula | C38H69O9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerols [GP04] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoglycerols [GP0403] |
PubChem Compound ID (CID) | - |
InChIKey | RQVRYJIXGIDMSU-QFQZJDEISA-N |
InChI | InChI=1S/C38H69O9P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-38(41)47-37(35 -46-48(42,43)45-33-36(40)32-39)34-44-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h11,1 3,17-18,20,22,29,31,36-37,39-40H,3-10,12,14-16,19,21,23-28,30,32-35H2,1-2H3,(H,4 2,43)/b13-11-,18-17-,22-20-,31-29-/t36-,37+/m0/s1 |
SMILES | [C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)CO/C=C\C CCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |